6-Bromo-2-chloro-3,4-difluoroaniline
Basic information
- CAS
139649-88-0- Standard SMILES
Nc1c(Br)cc(F)c(F)c1Cl- InChIKey
JBCJSSVKCJZWAW-UHFFFAOYSA-N- Molecular formula
- C6H3BrClF2N
- Average molar mass
- 242.45 g/mol
- Monoisotopic mass
- 240.91055
Names & identifiers
- Preferred name
- 6-Bromo-2-chloro-3,4-difluoroaniline
- IUPAC
- 6-bromo-2-chloro-3,4-difluoroaniline
Names & synonyms
6-Bromo-2-chloro-3,4-difluoroaniline139649-88-0SCHEMBL31727384DTXSID70693160MFCD193816556-bromo-2-chloro-3,4-difluoro-anilineF044824
Database identifiers
- CAS
139649-88-0- PubChem CID
- 53255487
- DTXSID
DTXSID70693160
Properties
Computed structural properties
- XLogP
- 2.8
- Topological polar surface area
- 26 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 3
- Rotatable bonds
- 0
- Heavy atoms
- 11
- Formal charge
- 0
- Complexity
- 149
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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